N-[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]benzamide

Systemtic Name: N-[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]benzamide Openeye Name: N-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]benzamide CAS Name: N-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrimidinyl]benzamide IUPAC Name: N-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]benzamide Traditional Name: N-[4-amino-5-(3,4,5-trimethoxybenzyl)pyrimidin-2-yl]benzamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O4/c1-27-16-10-13(11-17(28-2)18(16)29-3)9-15-12-23-21(24-19(15)22)25-20(26)14-7-5-4-6-8-14/h4-8,10-12H,9H2,1-3H3,(H3,22,23,24,25,26)